Tim Hempel

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Results 11 issues of Tim Hempel

GLH residue code

5 comment

Hi, I think the one-residue-code of GLH is wrong in `mdtraj.core.residue_names._AMINO_ACID_CODES`: https://github.com/mdtraj/mdtraj/blob/36b4cee61d936d9ecee875fbdde37120b59a4d51/mdtraj/core/residue_names.py#L107 It should be a protonated GLU (E), not a protonated GLN (Q).